7-(o-Nitrostyryl)benz(c)acridine
Basic information
- CAS
63021-49-8- Standard SMILES
O=[N+]([O-])c1ccccc1/C=C\c1c2ccccc2nc2c1ccc1ccccc12- InChIKey
HTKGLLSWBBPZFO-UHFFFAOYSA-N- Molecular formula
- C25H16N2O2
- Average molar mass
- 376.4 g/mol
- Monoisotopic mass
- 376.12117776
Names & identifiers
- Preferred name
- 7-(o-Nitrostyryl)benz(c)acridine
- IUPAC
- 7-[(Z)-2-(2-nitrophenyl)ethenyl]benzo[c]acridine
- English name
- 7-(o-Nitrostyryl)benz[c]acridine
- Molecular formula
- C25H16N2O2
- Molecular weight
- 376.41
Names & synonyms
BRN 00450827-(o-Nitrostyryl)benz(c)acridineBENZ(c)ACRIDINE, 7-(o-NITROSTYRYL)-o-Nitrobenzylidene-3,4-benz-9-methylacridine63021-49-87-(o-Nitrostyryl)benz[c]acridineBenz[c]acridine, 7-[2-(2-nitrophenyl)ethenyl]-
Database identifiers
- CAS
63021-49-8- PubChem CID
- 6434720
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 614
Physicochemical properties
- Melting point
- 198.5 · 198.5-199.5 °C(Solv: ethyl acetate (141-78-6))
- Boiling point
- 504.97 °C · 504.97°C (rough estimate)
- Density
- 1.2288 · 1.2288 (rough estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
- pka
- 4.78 · 4.78±0.30(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…